4-(6-bromanyl-2-oxidanyl-naphthalen-1-yl)-3-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: 4-(6-bromanyl-2-oxidanyl-naphthalen-1-yl)-3-oxidanyl-naphthalene-2-carboxylate Openeye Name: 4-(6-bromo-2-hydroxy-1-naphthyl)-3-hydroxy-naphthalene-2-carboxylate CAS Name: 4-(6-bromo-2-hydroxy-1-naphthalenyl)-3-hydroxy-2-naphthalenecarboxylate IUPAC Name: 4-(6-bromo-2-hydroxynaphthalen-1-yl)-3-hydroxynaphthalene-2-carboxylate Traditional Name: 4-(6-bromo-2-hydroxy-1-naphthyl)-3-hydroxy-2-naphthoate Formula: C21H12BrO4- MolecularWeight: 408.22158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=C2C3=C(C=CC4=C3C=CC(=C4)Br)O)O)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=C2C3=C(C=CC4=C3C=CC(=C4)Br)O)O)C(=O)[O-]

InChI

InChI=1S/C21H13BrO4/c22-13-6-7-15-12(9-13)5-8-17(23)18(15)19-14-4-2-1-3-11(14)10-16(20(19)24)21(25)26/h1-10,23-24H,(H,25,26)/p-1